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Details

Stereochemistry ACHIRAL
Molecular Formula C8H6Cl2O4S
Molecular Weight 269.102
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,5-Dichloro-4-(methylsulfonyl)benzoic acid

SMILES

CS(=O)(=O)C1=CC(Cl)=C(C=C1Cl)C(O)=O

InChI

InChIKey=BTURMIPTQDLHOE-UHFFFAOYSA-N
InChI=1S/C8H6Cl2O4S/c1-15(13,14)7-3-5(9)4(8(11)12)2-6(7)10/h2-3H,1H3,(H,11,12)

HIDE SMILES / InChI

Molecular Formula C8H6Cl2O4S
Molecular Weight 269.102
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:16:55 GMT 2025
Edited
by admin
on Wed Apr 02 19:16:55 GMT 2025
Record UNII
U394SPL73M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,5-Dichloro-4-(methylsulfonyl)benzoic acid
Systematic Name English
Benzoic acid, 2,5-dichloro-4-(methylsulfonyl)-
Preferred Name English
Code System Code Type Description
CAS
118939-22-3
Created by admin on Wed Apr 02 19:16:55 GMT 2025 , Edited by admin on Wed Apr 02 19:16:55 GMT 2025
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FDA UNII
U394SPL73M
Created by admin on Wed Apr 02 19:16:55 GMT 2025 , Edited by admin on Wed Apr 02 19:16:55 GMT 2025
PRIMARY
PUBCHEM
14257016
Created by admin on Wed Apr 02 19:16:55 GMT 2025 , Edited by admin on Wed Apr 02 19:16:55 GMT 2025
PRIMARY